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[5-(6,8-dibromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]acetonitrile
SpectraBase Compound ID HIVY1DsRcND
InChI InChI=1S/C14H6Br2N2O2S/c15-8-3-7-4-9(11-6-18-12(21-11)1-2-17)14(19)20-13(7)10(16)5-8/h3-6H,1H2
InChIKey PEKLAHCASIZUMO-UHFFFAOYSA-N
Mol Weight 426.08 g/mol
Molecular Formula C14H6Br2N2O2S
Exact Mass 423.851675 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JPcjRViyVog
Name [5-(6,8-dibromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]acetonitrile
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Formula C14H6Br2N2O2S
InChI InChI=1S/C14H6Br2N2O2S/c15-8-3-7-4-9(11-6-18-12(21-11)1-2-17)14(19)20-13(7)10(16)5-8/h3-6H,1H2
InChIKey PEKLAHCASIZUMO-UHFFFAOYSA-N
Molecular Weight 426.082 g/mol
SMILES C=1(C(Oc2c(C1)cc(cc2Br)Br)=O)c1sc(CC#N)nc1
SPLASH splash10-004i-4944800000-9f609150793bce6e9956
Synonyms 2-[5-(6,8-dibromo-2-keto-chromen-3-yl)thiazol-2-yl]acetonitrile 2-[5-(6,8-dibromo-2-oxo-1-benzopyran-3-yl)-2-thiazolyl]acetonitrile 2-[5-(6,8-dibromo-2-oxo-chromen-3-yl)thiazol-2-yl]acetonitrile 2-[5-(6,8-dibromo-2-oxochromen-3-yl)-1,3-thiazol-2-yl]acetonitrile 2-[5-[6,8-bis(bromanyl)-2-oxidanylidene-chromen-3-yl]-1,3-thiazol-2-yl]ethanenitrile
Wiley ID 1460728